UCSF

ZINC69263446

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 17 Yes

Popular Name: N-(cyclopropylmethyl)-N-ethyl-2-[4-(methylaminomethyl)triazol-1-yl]ethanamine N-(cyclopropylmethyl)-N-ethyl-2-…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.93 5.95 -95.14 3 5 2 52 239.367 8 ↓
Hi High (pH 8-9.5) 0.93 4.49 -45.9 2 5 1 47 238.359 8 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.